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Mol:FLIAEAGS0003 - Revision history
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Copyright: ARM project http://www.metabolome.jp/<br />
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M STY 1 2 SUP<br />
M SLB 1 2 2<br />
M SAL 2 2 43 44<br />
M SBL 2 1 47<br />
M SMT 2 CH2OH<br />
M SVB 2 47 -4.0205 1.7857<br />
M STY 1 1 SUP<br />
M SLB 1 1 1<br />
M SAL 1 2 41 42<br />
M SBL 1 1 45<br />
M SMT 1 OCH3<br />
M SVB 1 45 -0.0777 -0.3821<br />
S SKP 8<br />
ID FLIAEAGS0003<br />
KNApSAcK_ID C00010124<br />
NAME Tectorigenin 7-O-gentiobioside<br />
CAS_RN 67604-94-8<br />
FORMULA C28H32O16<br />
EXACTMASS 624.1690349759999<br />
AVERAGEMASS 624.54408<br />
SMILES [C@@H](OCC([C@@H]2O)O[C@@H](Oc(c5)c(c(O)c(c53)C(C(c(c4)ccc(O)c4)=CO3)=O)OC)[C@@H](O)[C@@H](O)2)([C@@H](O)1)OC(CO)[C@H](O)[C@@H]1O<br />
M END<br />
</pre></div>
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